[2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl] 1-oxidanylcyclohexane-1-carboxylate

Systemtic Name: [2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl] 1-oxidanylcyclohexane-1-carboxylate Openeye Name: [2-(2,6-dibromo-4-nitro-anilino)-2-oxo-ethyl] 1-hydroxycyclohexanecarboxylate CAS Name: 1-hydroxy-1-cyclohexanecarboxylic acid [2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl] 1-hydroxycyclohexane-1-carboxylate Traditional Name: 1-hydroxycyclohexanecarboxylic acid [2-(2,6-dibromo-4-nitro-anilino)-2-keto-ethyl] ester Formula: C15H16Br2N2O6 MolecularWeight: 480.10534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)OCC(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)O

Isomeric SMILES

C1CCC(CC1)(C(=O)OCC(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)O

InChI

InChI=1S/C15H16Br2N2O6/c16-10-6-9(19(23)24)7-11(17)13(10)18-12(20)8-25-14(21)15(22)4-2-1-3-5-15/h6-7,22H,1-5,8H2,(H,18,20)